Large-scale tight-binding simulations of quantum transport in ballistic graphene
arXiv:1805.10220 · doi:10.1088/1361-648X/aad6f1
Abstract
Graphene has proven to host outstanding mesoscopic effects involving massless Dirac quasiparticles travelling ballistically resulting in the current flow exhibiting light-like behaviour. A new branch of 2D electronics inspired by the standard principles of optics is rapidly evolving, calling for a deeper understanding of transport in large-scale devices at a quantum level. Here we perform large-scale quantum transport calculations based on a tight-binding model of graphene and the non-equilibrium Green's function method and include the effects of junctions of different shape, magnetic field, and absorptive regions acting as drains for current. We stress the importance of choosing absorbing boundary conditions in the calculations to correctly capture how current flows in the limit of infinite devices. As a specific application we present a fully quantum-mechanical framework for the "2D Dirac fermion microscope" recently proposed by Bøggild [Nat. Comm. 8, 10.1038 (2017)], tackling several key electron-optical effects therein predicted via semiclassical trajectory simulations, such as electron beam collimation, deflection and scattering off Veselago dots. Our results confirm that a semiclassical approach to a large extend is sufficient to capture the main transport features in the mesoscopic limit and the optical regime, but also that a richer electron-optical landscape is to be expected when coherence or other purely quantum effects are accounted for in the simulations.
arXiv comment12 pages, 10 figures
References in corpus (39)
- The electronic properties of graphene
- The SIESTA method for ab initio order-N materials simulation
- Efficient index handling of multidimensional periodic boundary conditions
- Density functional method for nonequilibrium electron transport
- Kwant: a software package for quantum transport
- Veselago Lens for Electrons: Focusing and Caustics in Graphene p-n Junctions
- Phase Coherent Transport of Charges in Graphene Quantum Billiard
- Improvements on non-equilibrium and transport Green function techniques: the next-generation transiesta
- Ballistic transport exceeding 28 μm in CVD grown graphene
- Electron optics with ballistic graphene junctions
- Electrically tunable transverse magnetic focusing in graphene
- Transport properties of 2D graphene containing structural defects
- Caustics due to Negative Refractive Index in Circular Graphene p-n Junctions
- Kubo-Greenwood Electrical Conductivity Formulation and Implementation for Projector Augmented Wave Datasets
- Tuning a Circular p-n Junction in Graphene from Quantum Confinement to Optical Guiding
- Scalable Tight-Binding Model for Graphene
- Spatial distribution of local currents of massless Dirac fermions in quantum transport through graphene nanoribbons
- Mie scattering analog in graphene: lensing, particle confinement, and depletion of Klein tunneling
- Conductance oscillations induced by ballistic snake states in a graphene heterojunction
- A Two-dimensional Dirac fermion microscope
- Monte-Carlo study of the electron transport properties of monolayer graphene within the tight-binding model
- Creating and Steering Highly Directional Electron Beams in Graphene
- Magnetoresistance in Disordered Graphene: The Role of Pseudospin and Dimensionality Effects Unraveled
- Revivals of quantum wave-packets in graphene
- Manipulating the voltage drop in graphene nanojunctions using a gate potential
- Absorptive pinhole collimators for ballistic Dirac fermions in graphene
- Patched Green's function techniques for two dimensional systems: Electronic behaviour of bubbles and perforations in graphene
- Complex absorbing potential based Lorentzian fitting scheme and time dependent quantum transport
- Efficient quantum transport simulation for bulk graphene heterojunctions
- Silicon and silicon-nitrogen impurities in graphene: structure, energetics and effects on electronic transport
- Tight-binding study of the magneto-optical properties of gapped graphene
- Edge effects in graphene nanostructures: II. Semiclassical theory of spectral fluctuations and quantum transport
- Scaling approach to tight-binding transport in realistic graphene devices: the case of transverse magnetic focusing
- Effect of the disorder in graphene grain boundaries: A wave packet dynamics study
- Husimi Maps in Lattices
- Semiclassical wavefunctions for open quantum billiards
- Scanning gate microscopy of magnetic focusing in graphene devices: quantum vs. classical simulation
- Grain boundary-induced variability of charge transport in hydrogenated polycrystalline graphene
- Understanding magnetic focusing in graphene - junctions through quantum modeling
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